============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. HIS 6 0.900 34.056 -6.231 -47.241 -99.200 -91.000 TYR 8 0.840 29.478 -9.086 -38.645 -99.200 -91.000 PHE 9 1.000 33.872 -12.364 -38.891 -99.200 -91.000 PHE 31 1.000 46.331 13.022 -43.979 -99.200 -91.000 TYR 74 0.840 42.928 10.378 -39.883 -99.200 -91.000 TYR 76 0.840 43.543 16.387 -41.536 -99.200 -91.000 TYR 107 0.840 43.589 20.605 -29.189 -99.200 -91.000 PHE 128 1.000 37.571 5.987 -19.252 -99.200 -91.000 TRP 133 1.040 32.186 3.819 -18.240 -99.200 -91.000 TRP6 133 1.020 32.814 3.252 -20.446 -99.200 -91.000 HIS 145 0.900 55.944 20.734 -40.009 -99.200 -91.000 PHE 154 1.000 48.185 11.020 -39.031 -99.200 -91.000 TRP 160 1.040 47.238 -4.635 -37.790 -99.200 -91.000 TRP6 160 1.020 45.889 -4.275 -39.697 -99.200 -91.000 TYR 161 0.840 42.064 -6.806 -36.704 -99.200 -91.000